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Home Carboxys 5-Bromo-4-carboxymethyl-2-chromanone

5-Bromo-4-carboxymethyl-2-chromanone

CAS No.:
1334499-95-4
Catalog Number:
AG0080HJ
Molecular Formula:
C11H9BrO4
Molecular Weight:
285.0908
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$150
- +
5g
98%
In Stock USA
United States
$450
- +
10g
98%
In Stock USA
United States
$750
- +
Product Description
Catalog Number:
AG0080HJ
Chemical Name:
5-Bromo-4-carboxymethyl-2-chromanone
CAS Number:
1334499-95-4
Molecular Formula:
C11H9BrO4
Molecular Weight:
285.0908
MDL Number:
MFCD20231489
IUPAC Name:
2-(5-bromo-2-oxo-3,4-dihydrochromen-4-yl)acetic acid
InChI:
InChI=1S/C11H9BrO4/c12-7-2-1-3-8-11(7)6(4-9(13)14)5-10(15)16-8/h1-3,6H,4-5H2,(H,13,14)
InChI Key:
BATNSUNQCYYYJI-UHFFFAOYSA-N
SMILES:
OC(=O)CC1CC(=O)Oc2c1c(Br)ccc2
Properties
Complexity:
304  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
283.968g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
285.093g/mol
Monoisotopic Mass:
283.968g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
63.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties